canSAR2257191
FEATURES
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NAMES
    SMILES
    COc1cc(C(C)(C)CN(C)C)c(C)cc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1
    InChI
    InChI=1S/C27H36ClN5O3S/c1-17(2)37(34,35)24-12-10-9-11-21(24)30-25-20(28)15-29-26(32-25)31-22-13-18(3)19(14-23(22)36-8)27(4,5)16-33(6)7/h9-15,17H,16H2,1-8H3,(H2,29,30,31,32)
    MOLECULAR FORMULA
    C27H36ClN5O3S
    CROSS REFERENCES
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    canSAR2257191
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight545.22
    AlogP5.96
    HBond donors2
    HBond acceptors8
    Atoms73
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2257191.